Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2f2a8a831932ac6cb5207bf7d3f55e52",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 49.91,
"b": 95.31,
"c": 99.44,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.43,1.8],
"number_observations_unique": 43510,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 12.3
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.9,1.8],
"number_observations_unique": 6048,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.454
},
{
"type": "R(pim)",
"value": 0.217
},
{
"type": "I/SigI",
"value": 2.8
},
{
"type": "Completeness",
"value": 94.8
},
{
"type": "CC(1/2)",
"value": 0.865
}
]
}
]
}